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Physical Review B

Dominant effect of anharmonicity on the equation of state and thermal conductivity of MgO under extreme conditions

Choah Kwon, Yi Xia, Fei Zhou* and Byungchan Han*


Chemistry of Materials

A Metal-induced Self-assembly Template for Controlled Growth of ZIF-8 Nanorods

Changjoon Keum, Hyesung Lee, Choah Kwon, Byungchan Han, Sang-Yup Lee*


ACS Sustainable Chemistry & Engineering

Pairing of Transition Metal Dichalcogenide and Doped Graphene for Catalytically Dual Acive Interfaces for Hydrogen Evolution Reaction

Kyungju Nam, Hoje Chun, Jeemin Hwang, Kyung-Ah Min, Byungchan Han*


Scientific Reports

Defect structure evolution of polyacrylonitrile and single wall carbon nanotube nanocomposites: A molecular dynamics simulation approach

So Jeong Heo, Kwang Ho Kim, Byungchan Han, Han Gi Chae, Seung Geol Lee


Journal of Materials Chemistry C

First-Principles Mechanism Study on Distinct Optoelectronic Properties of Cl-doped 2D Hybrid Tin Iodide Perovskite

Sung Jun Hong, Hoje Chun, Kyung-Ah Min and Byungchan Han*


Journal of Hazardous Materials

Unique Design of Superior Metal-Organic Framework for Removal of Toxic Chemicals in Humid Environment via Direct Functionalization of the Metal Nodes

Ga-Young Cha+, Hoje Chun+, Do-Young Hong, Jaegyeom Kim, Kyung-Ho Cho, U-Hwang Lee, Jong-San Chang, Sam Gon Ryu*, Hae Wan Leef, Seung-Joo Kimd*, Byungchan Han*, Young Kyu Hwang



Critical differences in 3D atomic structure of individual ligand-protected nanocrystals in solution

Byung Hyo Kim+, Junyoung Heo+, Sungin Kim, Cyril F. Reboul, Hoje Chun, Dohun Kang, Hyeonhu Bae, Hyejeong Hyun, Jongwoo Lim, Hoonkyung Lee, Byungchan Han, Taeghwan Hyeon, A. Paul Alivisatos, Peter Ercius*, Hans Elmlund*, Jungwon Park*


Applied Catalysis B

Copper Phosphosulfides as a Highly Active and Stable Photocatalyst for Hydrogen Evolution Reaction

Xiandi Zhang+, Kyung-Ah Min+, Weiran Zheng, Jeemin Hwang, Byungchan Han* and Lawrence Yoon Suk Lee*


Journal of Power Source

Ultrastable Molybdenum Disulfide-based Electrocatalyst for Hydrogen Evolution in Acidic Media

Yunxing Zhao+, Jeemin Hwang+, Michael Tang, Hoje Chun, Xingli Wang, Hu Zhao, Karen Chan, Byungchan Han*, Pingqi Gao* and Hong Li*


ACS Sustainable Chemistry & Engineering

First-Principles Design of Highly Functional Sulfide Electrolyte Li10-xSnP2S12-xClx for All Solid-State Li-ion Battery Applications

Kyungju Nam+, Hoje Chun+, Jeemin Hwang and Byungchan Han*



Thermochemical Study for Remediation of Highly Concentrated Acid Spill: Computational Modeling and Experimental Validation

Hyunwook Jung, Taesub Shin, Namjun Cho, Tae-kyung Kim, Jongwoon Kim, Tae In Ryu, Ki Bong Song, Seung-Ryul Hwang, Beyong-Hwan Ryu∗, Byungchan Han∗



Size-Extensive Molecular Machine Learning with Global Representations

Hyunwook Jung+, Sina Stocker+, Christian Kunkel, Harald Oberhofer, Byungchan Han, Karsten Reuter, Johannes T Margraf*


The Journal of Supercritical Fluids

Desulfurization of hexyl sulfide and hexanethiol using supercritical water

Jimoon Kang, Seungjae Sim, Hyunwook Jung, Byungchan Han, Youn-Woo Lee*


Applied Surface Science

First-Principles Computational Study of Ni/α-Al2O3 Hybrid Interface Reactions under Extreme Thermodynamic Conditions

Hoje Chun†, Daehyeon Choi†, Joonhee Kang, Jung Su Park and Byungchan Han*

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